Diastaphenazine

AlkaPlorer ID: AK043821

Synonym: 'Diastaphenazine'

IUPAC Name: 28-hydroxy-20-oxo-4,11,18,25-tetrazaheptacyclo[14.11.1.02,15.03,12.05,10.017,26.019,24]octacosa-2(15),3,5,7,9,11,13,17(26),21,23-decaene-9-carboxylic acid

Structure

SMILES: O=C(O)C1=CC=CC2=NC3=C4C(=CC=C3N=C12)C1C2=C(CC4C1O)N=C1C=CC=C(O)C1N2

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InChI: InChI=1S/C25H18N4O4/c30-17-6-2-5-14-21(17)29-23-16(26-14)9-12-18-10(19(23)24(12)31)7-8-15-22(18)28-13-4-1-3-11(25(32)33)20(13)27-15/h1-8,12,19,21,24,29-31H,9H2,(H,32,33)

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InChIKey: ZSCZBYPSTUVQGT-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 438.4430000000001

TPSA: 127.93

MolLogP: 3.0627000000000004

Number of H-Donors: 4

Number of H-Acceptors: 7

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information